(2-pentan-2-ylphenyl) 4-(4-octoxyphenyl)benzoate

Systemtic Name: (2-pentan-2-ylphenyl) 4-(4-octoxyphenyl)benzoate Openeye Name: [2-(1-methylbutyl)phenyl] 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid (2-pentan-2-ylphenyl) ester IUPAC Name: (2-pentan-2-ylphenyl) 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid [2-(1-methylbutyl)phenyl] ester Formula: C32H40O3 MolecularWeight: 472.6582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(C)CCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(C)CCC

InChI

InChI=1S/C32H40O3/c1-4-6-7-8-9-12-24-34-29-22-20-27(21-23-29)26-16-18-28(19-17-26)32(33)35-31-15-11-10-14-30(31)25(3)13-5-2/h10-11,14-23,25H,4-9,12-13,24H2,1-3H3